5-{2-[(butan-2-yl)sulfamoyl]-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy}-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-{2-[(butan-2-yl)sulfamoyl]-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy}-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
5-{2-[(butan-2-yl)sulfamoyl]-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy}-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V007-0127 |
| Compound Name: | 5-{2-[(butan-2-yl)sulfamoyl]-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy}-1,4-dimethyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 584.57 |
| Molecular Formula: | C25 H27 F3 N4 O7 S |
| Salt: | not_available |
| Smiles: | CCC(C)NS(c1cc(ccc1Oc1c(C)c(C(O)=O)nn1C)NC(c1ccc(c(c1)C(F)(F)F)OC)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4385 |
| logD: | 0.7255 |
| logSw: | -3.9417 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 122.436 |
| InChI Key: | NXECHCFXZSRENH-ZDUSSCGKSA-N |